# generated using pymatgen
data_Li5Fe8(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.22928200
_cell_length_b   9.13762429
_cell_length_c   10.09870055
_cell_angle_alpha   88.76211487
_cell_angle_beta   88.62656723
_cell_angle_gamma   89.26526828
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Fe8(BO3)8
_chemical_formula_sum   'Li5 Fe8 B8 O24'
_cell_volume   482.26060058
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Li  Li0  1  0.15093400  0.17303400  0.65287100  1
  Li  Li1  1  0.33051200  0.33012000  0.40472300  1
  Li  Li2  1  0.32694300  0.32458000  0.91932500  1
  Li  Li3  1  0.82546400  0.82630900  0.41581800  1
  Li  Li4  1  0.83020400  0.82569400  0.91543600  1
  Fe  Fe5  1  0.17422400  0.82694400  0.63260800  1
  Fe  Fe6  1  0.16540800  0.50484800  0.13297300  1
  Fe  Fe7  1  0.32381100  0.99910700  0.88133300  1
  Fe  Fe8  1  0.35069000  0.65804800  0.37645600  1
  Fe  Fe9  1  0.65843000  0.34882200  0.63049600  1
  Fe  Fe10  1  0.66613200  0.00391300  0.13440100  1
  Fe  Fe11  1  0.84611700  0.16388300  0.37731100  1
  Fe  Fe12  1  0.81550900  0.50558800  0.87874800  1
  B  B13  1  0.15318700  0.49717600  0.62478700  1
  B  B14  1  0.16801400  0.83295000  0.12746700  1
  B  B15  1  0.33808700  0.99752100  0.38290500  1
  B  B16  1  0.33023500  0.66735700  0.87986200  1
  B  B17  1  0.67309300  0.00339000  0.62641200  1
  B  B18  1  0.66796500  0.33268300  0.12585900  1
  B  B19  1  0.83591600  0.49830600  0.37361400  1
  B  B20  1  0.82484800  0.16785800  0.87751100  1
  O  O21  1  0.09816100  0.48305600  0.33422500  1
  O  O22  1  0.08890500  0.17134200  0.85812700  1
  O  O23  1  0.17799100  0.78837900  0.83439500  1
  O  O24  1  0.21019400  0.86925200  0.42341700  1
  O  O25  1  0.22122800  0.13058000  0.38752700  1
  O  O26  1  0.20372600  0.54043600  0.92361400  1
  O  O27  1  0.28356300  0.36598500  0.60585100  1
  O  O28  1  0.32467700  0.94914900  0.09006500  1
  O  O29  1  0.26754800  0.62931500  0.58643000  1
  O  O30  1  0.27488800  0.70125900  0.16776000  1
  O  O31  1  0.40730000  0.34777200  0.11801700  1
  O  O32  1  0.40920100  0.99550600  0.66072400  1
  O  O33  1  0.59691900  0.98398200  0.33924400  1
  O  O34  1  0.58668900  0.68003800  0.88170700  1
  O  O35  1  0.67456800  0.29005300  0.85113400  1
  O  O36  1  0.70237600  0.37226300  0.40900800  1
  O  O37  1  0.72538700  0.63327100  0.37748100  1
  O  O38  1  0.70768600  0.03736400  0.92221500  1
  O  O39  1  0.82550900  0.44785900  0.09014700  1
  O  O40  1  0.81734700  0.87650500  0.62023200  1
  O  O41  1  0.78396900  0.13609900  0.59532200  1
  O  O42  1  0.77596400  0.19942300  0.16521400  1
  O  O43  1  0.90852600  0.84869700  0.11665000  1
  O  O44  1  0.90954900  0.49819200  0.67575200  1
